Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.69 |
| ▸ | COMT | P21964 | 4/20 | 0.63 |
| ▸ | LMNA | P02545 | 4/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.62 |
| ▸ | HTT | P42858 | 3/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.62 |
| ▸ | MITF | O75030 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL17962379 | 1.00 | ALDH1A1 (0.69) | ALDH1A1COMTLMNAKDM4EL3MBTL1 | |
| SCHEMBL17962362 | 0.84 | COMT (0.64) | ALDH1A1COMTLMNAKDM4EL3MBTL1 | |
| SCHEMBL17962417 | 0.80 | COMT (0.78) | ALDH1A1COMTLMNAKDM4EL3MBTL1 | |
| SCHEMBL17962335 | 0.79 | COMT (0.73) | ALDH1A1COMTLMNAKDM4EHTT | |
| SCHEMBL17962274 | 0.79 | COMT (0.65) | ALDH1A1COMTLMNAKDM4EL3MBTL1 | |
| SCHEMBL17960049 | 0.78 | COMT (1.00) | COMTKDM4ESMN1; SMN2 | |
| SCHEMBL17962384 | 0.78 | COMT (0.64) | ALDH1A1COMTLMNAKDM4EHTT | |
| SCHEMBL17962361 | 0.78 | COMT (0.64) | ALDH1A1COMTLMNAKDM4EHTT | |
| SCHEMBL17962271 | 0.77 | KDM4E (1.00) | ALDH1A1COMTKDM4ESMN1; SMN2 | |
| SCHEMBL17962265 | 0.76 | COMT (0.68) | ALDH1A1COMTLMNAKDM4EHTT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3250209-B1 | COMT INHIBITING METHODS AND COMPOSITIONS | LIEBER INST FOR BRAIN DEVELOPMENT (US) | 2023-09-13 | — | — | EP | claimed |
| EP-3250209-B1 | COMT INHIBITING METHODS AND COMPOSITIONS | LIEBER INST FOR BRAIN DEVELOPMENT (US) | 2023-09-13 | — | — | EP | disclosed |